SpectraBase Compound ID | FoetkxgspKl |
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InChI | InChI=1S/C5H11NO2/c1-4(7)3-6-5(2)8/h4,7H,3H2,1-2H3,(H,6,8) |
InChIKey | YKDZEZDQPMEHGB-UHFFFAOYSA-N |
Mol Weight | 117.15 g/mol |
Molecular Formula | C5H11NO2 |
Exact Mass | 117.078979 g/mol |
SpectraBase Spectrum ID | BPCMWZuSqfl |
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Name | Acetamide, N-(2-hydroxypropyl)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 117.078978596 u |
Formula | C5H11NO2 |
InChI | InChI=1S/C5H11NO2/c1-4(7)3-6-5(2)8/h4,7H,3H2,1-2H3,(H,6,8) |
InChIKey | YKDZEZDQPMEHGB-UHFFFAOYSA-N |
Molecular Weight | 117.148 g/mol |
SMILES | C(O)(CNC(C)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.979392 |